dicyclohexylazanium; 2-diethoxyphosphoryl-3-(1-oxidanylnaphthalen-2-yl)propanoate

Systemtic Name: dicyclohexylazanium; 2-diethoxyphosphoryl-3-(1-oxidanylnaphthalen-2-yl)propanoate Openeye Name: dicyclohexylammonium; 2-diethoxyphosphoryl-3-(1-hydroxy-2-naphthyl)propanoate CAS Name: dicyclohexylammonium; 2-diethoxyphosphoryl-3-(1-hydroxy-2-naphthalenyl)propanoate IUPAC Name: dicyclohexylazanium; 2-diethoxyphosphoryl-3-(1-hydroxynaphthalen-2-yl)propanoate Traditional Name: dicyclohexylammonium; 2-diethoxyphosphoryl-3-(1-hydroxy-2-naphthyl)propionate Formula: C29H44NO6P MolecularWeight: 533.636521

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(CC1=C(C2=CC=CC=C2C=C1)O)C(=O)[O-])OCC.C1CCC(CC1)[NH2+]C2CCCCC2

Isomeric SMILES

CCOP(=O)(C(CC1=C(C2=CC=CC=C2C=C1)O)C(=O)[O-])OCC.C1CCC(CC1)[NH2+]C2CCCCC2

InChI

InChI=1S/C17H21O6P.C12H23N/c1-3-22-24(21,23-4-2)15(17(19)20)11-13-10-9-12-7-5-6-8-14(12)16(13)18;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h5-10,15,18H,3-4,11H2,1-2H3,(H,19,20);11-13H,1-10H2